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Unverified Commit e9974d17 authored by Xavier Robin's avatar Xavier Robin
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feat: add lDDT

parent 3b45117a
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......@@ -14,10 +14,13 @@ else:
ent_full = ost.io.LoadPDB('3ia3', remote=True)
ent_1 = ent_full.Select('cname=A,D')
ent_2 = ent_full.Select('cname=B,C')
# get score
ost.PushVerbosityLevel(3)
# get scores
ost.PushVerbosityLevel(3)
try:
scorer = scoring.Scorer(ent_1, ent_2)
ost.LogScript('lDDT:', str(scorer.lddt))
ost.LogScript('QSscore:', str(scorer.qs_global))
ost.LogScript('Chain mapping used:', str(scorer.mapping.GetFlatMapping()))
except qsscoring.QSscoreError as ex:
......
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